Vitas-M small molecule compound
2-[(5-{2-[(2,4-dimethylphenyl)amino]-2-oxoethyl}-4-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(morpholin-4-yl)phenyl]acetamide
Catalog ID
STK297289
SMILES CCn1c(SCC(=O)Nc2ccc(cc2)N2CCOCC2)nnc1CC(=O)Nc1ccc(cc1C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C26H32N6O3S MW 508.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H32N6O3S/c1-4-32-23(16-24(33)28-22-10-5-18(2)15-19(22)3)29-30-26(32)36-17-25(34)27-20-6-8-21(9-7-20)31-11-13-35-14-12-31/h5-10,15H,4,11-14,16-17H2,1-3H3,(H,27,34)(H,28,33)InChIKey
ILUPPCCXSAWKNU-UHFFFAOYSA-NSynonyms
2((5(2((24DIMETHYLPHENYL)AMINO)2OXOETHYL)4ETHYL4H124TRIAZOL3YL)SULFANYL)N(4(MORPHOLIN4YL)PHENYL)ACETAMIDE
CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)N3CCOCC3)CC(=O)NC4=C(C=C(C=C4)C)C
InChI=1SC26H32N6O3Sc143223(1624(33)282210518(2)1519(22)3)293026(32)361725(34)27206821(9720)31111335141231h51015H411141617H213H3(H2734)(H2833)
MFCD09960879
N(24DIMETHYLPHENYL)2(4ETHYL5((4MORPHOLIN4YLPHENYLCARBAMOYL)METHYLSULFANYL)4H(124)TRIAZOL3YL)ACETAMIDE
N(24dimethylphenyl)2(4ethyl5(2(4morpholin4ylanilino)2oxoethyl)sulfanyl124triazol3yl)acetamide
ZINC000013956149
ZINC13956149
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